ChemSpider 2D Image | 4-(~2~H_7_)Propyl(~2~H_4_)benzoic acid | C10HD11O2

4-(2H7)Propyl(2H4)benzoic acid

  • Molecular FormulaC10HD11O2
  • Average mass175.269 Da
  • Monoisotopic mass175.152771 Da
  • ChemSpider ID74082438

  • Non-standard isotope - Non-standard isotope

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

4-(2H7)Propyl(2H4)benzoesäure [German] [ACD/IUPAC Name]
4-(2H7)Propyl(2H4)benzoic acid [ACD/IUPAC Name]
Acide 4-(2H7)propyl(2H4)benzoïque [French] [ACD/IUPAC Name]
Benzoic-2,3,5,6-d4 acid, 4-(propyl-d7)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 285.1±19.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 55.4±3.0 kJ/mol
Flash Point: 133.4±16.2 °C
Index of Refraction: 1.539
Molar Refractivity: 47.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.42
ACD/LogD (pH 5.5): 2.07
ACD/BCF (pH 5.5): 11.55
ACD/KOC (pH 5.5): 94.19
ACD/LogD (pH 7.4): 0.44
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.21
Polar Surface Area: 37 Å2
Polarizability: 18.8±0.5 10-24cm3
Surface Tension: 42.3±3.0 dyne/cm
Molar Volume: 151.3±3.0 cm3

Click to predict properties on the Chemicalize site


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